CID 62074318

6-amino-n-benzyl-n-methylpyridine-3-carboxamide

Structural Information

Molecular Formula
C14H15N3O
SMILES
CN(CC1=CC=CC=C1)C(=O)C2=CN=C(C=C2)N
InChI
InChI=1S/C14H15N3O/c1-17(10-11-5-3-2-4-6-11)14(18)12-7-8-13(15)16-9-12/h2-9H,10H2,1H3,(H2,15,16)
InChIKey
LQSZUVDTNDVMED-UHFFFAOYSA-N
Compound name
6-amino-N-benzyl-N-methylpyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.1215 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.128776 155.2
[M+Na]+ 264.110718 161.2
[M-H]- 240.114224 161.4
[M+NH4]+ 259.155323 170.8
[M+K]+ 280.084658 158.5
[M+H-H2O]+ 224.118760 146.2
[M+HCOO]- 286.119701 179.7
[M+CH3COO]- 300.135351 199.8
[M+Na-2H]- 262.096166 160.5
[M]+ 241.12095142 154.0
[M]- 241.12204858 154.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.